5-fluoro-N-[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]-1H-indole-2-carboxamide

C23H26FN3O2 — CID 39982579

IUPAC5-fluoro-N-[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]-1H-indole-2-carboxamide
SMILESCOc1ccc([C@H](CNC(=O)c2cc3cc(F)ccc3[nH]2)N2CCCCC2)cc1
InChIInChI=1S/C23H26FN3O2/c1-29-19-8-5-16(6-9-19)22(27-11-3-2-4-12-27)15-25-23(28)21-14-17-13-18(24)7-10-20(17)26-21/h5-10,13-14,22,26H,2-4,11-12,15H2,1H3,(H,25,28)/t22-/m0/s1
InChIKeyPLTHLILPIJDRSU-QFIPXVFZSA-N
MW395.48 g/mol
LogP4.27
Rot. Bonds6

About 5-fluoro-N-[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]-1H-indole-2-carboxamide

5-fluoro-N-[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]-1H-indole-2-carboxamide (PubChem CID 39982579) has the molecular formula C23H26FN3O2 and a molecular weight of 395.48 g/mol. Its IUPAC name is 5-fluoro-N-[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]-1H-indole-2-carboxamide.

Molecular Properties

Compound Name5-fluoro-N-[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]-1H-indole-2-carboxamide
PubChem CID39982579
Molecular FormulaC23H26FN3O2
Molecular Weight395.48 g/mol
Exact Mass395.20
IUPAC Name5-fluoro-N-[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]-1H-indole-2-carboxamide
SMILESCOc1ccc([C@H](CNC(=O)c2cc3cc(F)ccc3[nH]2)N2CCCCC2)cc1
InChIInChI=1S/C23H26FN3O2/c1-29-19-8-5-16(6-9-19)22(27-11-3-2-4-12-27)15-25-23(28)21-14-17-13-18(24)7-10-20(17)26-21/h5-10,13-14,22,26H,2-4,11-12,15H2,1H3,(H,25,28)/t22-/m0/s1
InChIKeyPLTHLILPIJDRSU-QFIPXVFZSA-N
XLogP4.27
TPSA57.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.48
LogP ≤ 54.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 5-fluoro-N-[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]-1H-indole-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-fluoro-N-[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]benzamide
CID 2521454
5-fluoro-N-[2-hydroxy-2-(3-methoxyphenyl)ethyl]-1H-indole-2-carboxamide
CID 111115526
1-(4-fluorophenyl)-3-[2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]urea
CID 43016379
2-(3-fluorophenyl)-N-[2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]acetamide
CID 43006555
2-(4-fluorophenoxy)-N-[2-(4-methoxyphenyl)-2-pyrrolidin-1-ylethyl]acetamide
CID 17014584
3-fluoro-N-[2-(4-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-4-methylbenzamide
CID 24544219
(2R)-2-(4-fluorophenoxy)-N-[(2S)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ylethyl]propanamide
CID 31140460
4-acetyl-N-[2-(4-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-1H-pyrrole-2-carboxamide
CID 24544227
2,4-difluoro-N-[2-[[2-(4-methoxyphenyl)-2-pyrrolidin-1-ylethyl]amino]-2-oxoethyl]benzamide
CID 134036254
N-[2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]-3,5-bis(trifluoromethyl)benzamide
CID 4841220
5-fluoro-N-[2-(4-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-3-methyl-1-benzofuran-2-carboxamide;hydrochloride
CID 52985399
3-(4-fluorophenyl)-N-[2-(4-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-2-sulfanylidene-1H-imidazole-4-carboxamide
CID 24544205

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-N-[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]-1H-indole-2-carboxamide?
The IUPAC name of 5-fluoro-N-[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]-1H-indole-2-carboxamide (CID 39982579) is 5-fluoro-N-[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]-1H-indole-2-carboxamide.
What is the SMILES notation for 5-fluoro-N-[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]-1H-indole-2-carboxamide?
The canonical SMILES for 5-fluoro-N-[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]-1H-indole-2-carboxamide is COc1ccc([C@H](CNC(=O)c2cc3cc(F)ccc3[nH]2)N2CCCCC2)cc1.
What is the InChIKey of 5-fluoro-N-[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]-1H-indole-2-carboxamide?
The InChIKey is PLTHLILPIJDRSU-QFIPXVFZSA-N. The full InChI is InChI=1S/C23H26FN3O2/c1-29-19-8-5-16(6-9-19)22(27-11-3-2-4-12-27)15-25-23(28)21-14-17-13-18(24)7-10-20(17)26-21/h5-10,13-14,22,26H,2-4,11-12,15H2,1H3,(H,25,28)/t22-/m0/s1.
What are the key properties of 5-fluoro-N-[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]-1H-indole-2-carboxamide?
5-fluoro-N-[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]-1H-indole-2-carboxamide has a molecular weight of 395.48 g/mol, XLogP of 4.27, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-N-[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]-1H-indole-2-carboxamide is sourced from PubChem (CID 39982579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).